N-[[(1S,2S)-2-oxidanylcyclopentyl]methyl]-N-(phenylmethyl)-2-piperazin-1-yl-pyridine-3-carboxamide

Systemtic Name: N-[[(1S,2S)-2-oxidanylcyclopentyl]methyl]-N-(phenylmethyl)-2-piperazin-1-yl-pyridine-3-carboxamide Openeye Name: N-benzyl-N-[[(1S,2S)-2-hydroxycyclopentyl]methyl]-2-piperazin-1-yl-pyridine-3-carboxamide CAS Name: N-[[(1S,2S)-2-hydroxycyclopentyl]methyl]-N-(phenylmethyl)-2-(1-piperazinyl)-3-pyridinecarboxamide IUPAC Name: N-benzyl-N-[[(1S,2S)-2-hydroxycyclopentyl]methyl]-2-piperazin-1-ylpyridine-3-carboxamide Traditional Name: N-benzyl-N-[[(1S,2S)-2-hydroxycyclopentyl]methyl]-2-piperazino-nicotinamide Formula: C23H30N4O2 MolecularWeight: 394.5099

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C1)O)CN(CC2=CC=CC=C2)C(=O)C3=C(N=CC=C3)N4CCNCC4

Isomeric SMILES

C1C[C@H]([C@H](C1)O)CN(CC2=CC=CC=C2)C(=O)C3=C(N=CC=C3)N4CCNCC4

InChI

InChI=1S/C23H30N4O2/c28-21-10-4-8-19(21)17-27(16-18-6-2-1-3-7-18)23(29)20-9-5-11-25-22(20)26-14-12-24-13-15-26/h1-3,5-7,9,11,19,21,24,28H,4,8,10,12-17H2/t19-,21-/m0/s1